6.BETA.-HYDROXYBUDESONIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C25H34O7
Molecular Weight	446.5333
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])C[C@@H](O)C5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]1(OC(CCC)O2)C(=O)CO

InChI

InChIKey=JBVVDXJXIDYDMF-GVTADUIWSA-N

InChI=1S/C25H34O7/c1-4-5-21-31-20-10-15-14-9-17(28)16-8-13(27)6-7-23(16,2)22(14)18(29)11-24(15,3)25(20,32-21)19(30)12-26/h6-8,14-15,17-18,20-22,26,28-29H,4-5,9-12H2,1-3H3/t14-,15-,17+,18-,20+,21?,22+,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H34O7
Molecular Weight	446.5333
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	8 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:45:06 GMT 2023` Edited by `admin` on `Sat Dec 16 08:45:06 GMT 2023`
Record UNII	0J80E95H99
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.BETA.-HYDROXYBUDESONIDE

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 16,17-(BUTYLIDENEBIS(OXY))-6,11,21-TRIHYDROXY-, (6.BETA.,11.BETA.,16.ALPHA.)-

Systematic Name

English

Code System Code Type Description

CAS

88411-77-2